1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine

C9H17N3O — CID 163581197

IUPAC1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine
SMILESCN(Nc1ccc[nH]1)OC(C)(C)C
InChIInChI=1S/C9H17N3O/c1-9(2,3)13-12(4)11-8-6-5-7-10-8/h5-7,10-11H,1-4H3
InChIKeyGHQZUOUENSZXOU-UHFFFAOYSA-N
MW183.25 g/mol
LogP2.00
Rot. Bonds3

About 1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine

1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine (PubChem CID 163581197) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine.

Molecular Properties

Compound Name1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine
PubChem CID163581197
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine
SMILESCN(Nc1ccc[nH]1)OC(C)(C)C
InChIInChI=1S/C9H17N3O/c1-9(2,3)13-12(4)11-8-6-5-7-10-8/h5-7,10-11H,1-4H3
InChIKeyGHQZUOUENSZXOU-UHFFFAOYSA-N
XLogP2.00
TPSA40.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(1H-pyrrol-2-yl)-1H-pyrrol-2-amine
CID 68544991
N,N'-bis(1H-pyrrol-2-yl)ethane-1,2-diamine
CID 163759001
methyl 2-methyl-2-(1H-pyrrol-2-ylamino)propanoate
CID 115128260
lithium;N-ethyl-1H-pyrrol-2-amine;hydride
CID 173205429
N-iodosyl-1H-pyrrol-2-amine
CID 163738400
N,2-dimethyl-N-(1H-pyrrol-2-ylmethoxy)propan-2-amine
CID 163853856
N-methyl-N'-(1H-pyrrol-2-yl)propane-1,3-diamine
CID 115197680
4-amino-3,3-dimethyl-N-(1H-pyrrol-2-yl)butanamide
CID 115157201
4-amino-N,2,2-trimethyl-N-(1H-pyrrol-2-yl)butanamide
CID 115156967
1H-pyrrol-2-ylcarbamic acid
CID 57129797
2-propan-2-yl-N'-(1H-pyrrol-2-yl)propane-1,3-diamine
CID 115252329
N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1H-pyrrol-2-amine
CID 115244513

Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine?
The IUPAC name of 1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine (CID 163581197) is 1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine.
What is the SMILES notation for 1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine?
The canonical SMILES for 1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine is CN(Nc1ccc[nH]1)OC(C)(C)C.
What is the InChIKey of 1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine?
The InChIKey is GHQZUOUENSZXOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-9(2,3)13-12(4)11-8-6-5-7-10-8/h5-7,10-11H,1-4H3.
What are the key properties of 1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine?
1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine has a molecular weight of 183.25 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-[(2-methylpropan-2-yl)oxy]-2-(1H-pyrrol-2-yl)hydrazine is sourced from PubChem (CID 163581197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).